C540-0117 Screening compound: 1-[6-(4-fluorophenyl)-3-methylimidazo[2,1-b][1,3]thiazole-2-carbonyl]-2-methylpiperidine

C540-0117 Screening compound: 1-[6-(4-fluorophenyl)-3-methylimidazo[2,1-b][1,3]thiazole-2-carbonyl]-2-methylpiperidine
C540-0117 Screening compound: 1-[6-(4-fluorophenyl)-3-methylimidazo[2,1-b][1,3]thiazole-2-carbonyl]-2-methylpiperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound C540-0117
1-[6-(4-fluorophenyl)-3-methylimidazo[2,1-b][1,3]thiazole-2-carbonyl]-2-methylpiperidine

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

C540-0117

Molecular Formula

C19H20FN3OS (C19 H20 FN3 OS)

Compound Name

1-[6-(4-fluorophenyl)-3-methylimidazo[2,1-b][1,3]thiazole-2-carbonyl]-2-methylpiperidine

IUPAC name

1-[6-(4-fluorophenyl)-3-methylimidazo[21-b][13]thiazole-2-carbonyl]-2-methylpiperidine

SMILES

CC(CCCC1)N1C(c(s1)c(C)n2c1nc(-c(cc1)ccc1F)c2)=O

InChI

InChI=1S/C19H20FN3OS/c1-12-5-3-4-10-22(12)18(24)17-13(2)23-11-16(21-19(23)25-17)14-6-8-15(20)9-7-14/h6-9,11-12H,3-5,10H2,1-2H3/t12-/m0/s1

InChI Key

FXAFQFOGUKQPGR-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD04468964

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.104

Distribution Coefficient, logD

4.103

Water Solubility, LogSw

-3.99

Polar Surface Area

25.375

Acid Dissociation Constant (pKa)

26.41

Base Dissociation Constant (pKb)

4.82

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.80

C540-0117 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C540-0117 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C540-0117?
Check Price and Availability of C540-0117, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C540-0117 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C540-0117
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C540-0117
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of C540-0117 available by request